SCHEMBL4599992

SCHEMBL4599992

CCCc1ccc(OC(C)C)cc1Oc1ncc(C(F)(F)F)cc1Cl

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARG P37231 14/20 0.71
LMNA P02545 2/20 0.49
ALDH1A1 P00352 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3209429 0.91 PPARG (0.65) PPARGLMNAALDH1A1SMN1; SMN2
SCHEMBL3207968 0.89 PPARG (0.68) PPARGLMNASMN1; SMN2
SCHEMBL3202784 0.88 PPARG (0.65) PPARGLMNAALDH1A1SMN1; SMN2
SCHEMBL5111589 0.88 PPARG (0.67) PPARGLMNASMN1; SMN2
SCHEMBL3205204 0.88 PPARG (0.72) PPARGLMNASMN1; SMN2
SCHEMBL5114186 0.87 PPARG (0.66) PPARGLMNAALDH1A1SMN1; SMN2
SCHEMBL3204993 0.86 PPARG (0.71) PPARGLMNASMN1; SMN2
SCHEMBL5120778 0.83 PPARG (0.62) PPARGLMNASMN1; SMN2
SCHEMBL3204436 0.82 PPARG (0.55) PPARGLMNAALDH1A1SMN1; SMN2
SCHEMBL6901995 0.81 SMN1; SMN2 (0.64) PPARGLMNAALDH1A1SMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1912645-A2 THERAPEUTIC AGENT FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2008-04-23 EP disclosed
WO-2007018314-A2 THERAPEUTIC AGENT FOR DIABETES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-15 WO disclosed